ethyl (2S)-2-(octanoylamino)propanoate

Systemtic Name: ethyl (2S)-2-(octanoylamino)propanoate Openeye Name: ethyl (2S)-2-(octanoylamino)propanoate CAS Name: (2S)-2-(1-oxooctylamino)propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-(octanoylamino)propanoate Traditional Name: (2S)-2-(caprylylamino)propionic acid ethyl ester Formula: C13H25NO3 MolecularWeight: 243.3425

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(C)C(=O)OCC

Isomeric SMILES

CCCCCCCC(=O)N[C@@H](C)C(=O)OCC

InChI

InChI=1S/C13H25NO3/c1-4-6-7-8-9-10-12(15)14-11(3)13(16)17-5-2/h11H,4-10H2,1-3H3,(H,14,15)/t11-/m0/s1